N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide

C15H28N4O — CID 70287277

IUPACN-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCC(N(C)C2CCCC=N2)CC1
InChIInChI=1S/C15H28N4O/c1-13(20)16-9-12-19-10-6-14(7-11-19)18(2)15-5-3-4-8-17-15/h8,14-15H,3-7,9-12H2,1-2H3,(H,16,20)
InChIKeyGTOSFNBZOKUJCE-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.10
Rot. Bonds5

About N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide

N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide (PubChem CID 70287277) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide
PubChem CID70287277
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC NameN-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CCC(N(C)C2CCCC=N2)CC1
InChIInChI=1S/C15H28N4O/c1-13(20)16-9-12-19-10-6-14(7-11-19)18(2)15-5-3-4-8-17-15/h8,14-15H,3-7,9-12H2,1-2H3,(H,16,20)
InChIKeyGTOSFNBZOKUJCE-UHFFFAOYSA-N
XLogP1.10
TPSA47.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide (CID 70287277) is N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide is CC(=O)NCCN1CCC(N(C)C2CCCC=N2)CC1.
What is the InChIKey of N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide?
The InChIKey is GTOSFNBZOKUJCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-13(20)16-9-12-19-10-6-14(7-11-19)18(2)15-5-3-4-8-17-15/h8,14-15H,3-7,9-12H2,1-2H3,(H,16,20).
What are the key properties of N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide?
N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide has a molecular weight of 280.42 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[methyl(2,3,4,5-tetrahydropyridin-2-yl)amino]piperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 70287277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).